Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16410650 | 0.83 | CYP1A2 (0.34) | KDM4E | |
| SCHEMBL16410822 | 0.75 | HTT (0.34) | ALDH1A1HTT | |
| SCHEMBL16410701 | 0.74 | PIK3CA (0.33) | — | |
| SCHEMBL16410595 | 0.74 | P2RX7 (0.32) | — | |
| SCHEMBL16410683 | 0.74 | PIK3CA (0.32) | — | |
| SCHEMBL16410845 | 0.74 | DHFR (0.31) | ALDH1A1 | |
| SCHEMBL16410718 | 0.73 | PIK3CA (0.34) | — | |
| SCHEMBL16410793 | 0.72 | CYP1A2 (0.34) | KDM4E | |
| SCHEMBL16410536 | 0.72 | TSHR (0.35) | ALDH1A1 | |
| SCHEMBL16410626 | 0.71 | NOS3 (0.34) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015007730-A1 | SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2015-01-22 | — | — | WO | disclosed |